10-[[4-methyl-2-(4-oxidanyl-4-oxidanylidene-butoxy)phenyl]amino]-10-oxidanylidene-decanoic acid

Systemtic Name: 10-[[4-methyl-2-(4-oxidanyl-4-oxidanylidene-butoxy)phenyl]amino]-10-oxidanylidene-decanoic acid Openeye Name: 10-[2-(4-hydroxy-4-oxo-butoxy)-4-methyl-anilino]-10-oxo-decanoic acid CAS Name: 10-[2-(4-hydroxy-4-oxobutoxy)-4-methylanilino]-10-oxodecanoic acid IUPAC Name: 10-[2-(4-hydroxy-4-oxobutoxy)-4-methylanilino]-10-oxodecanoic acid Traditional Name: 10-[2-(4-hydroxy-4-keto-butoxy)-4-methyl-anilino]-10-keto-capric acid Formula: C21H31NO6 MolecularWeight: 393.47394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CCCCCCCCC(=O)O)OCCCC(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CCCCCCCCC(=O)O)OCCCC(=O)O

InChI

InChI=1S/C21H31NO6/c1-16-12-13-17(18(15-16)28-14-8-11-21(26)27)22-19(23)9-6-4-2-3-5-7-10-20(24)25/h12-13,15H,2-11,14H2,1H3,(H,22,23)(H,24,25)(H,26,27)